6-[[1-(4-bromophenyl)sulfonylpiperidin-4-yl]carbonylamino]hexanoate

Systemtic Name: 6-[[1-(4-bromophenyl)sulfonylpiperidin-4-yl]carbonylamino]hexanoate Openeye Name: 6-[[1-(4-bromophenyl)sulfonylpiperidine-4-carbonyl]amino]hexanoate CAS Name: 6-[[[1-(4-bromophenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]hexanoate IUPAC Name: 6-[[1-(4-bromophenyl)sulfonylpiperidine-4-carbonyl]amino]hexanoate Traditional Name: 6-[(1-brosylisonipecotoyl)amino]hexanoate Formula: C18H24BrN2O5S- MolecularWeight: 460.36256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCCCCC(=O)[O-])S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C1CN(CCC1C(=O)NCCCCCC(=O)[O-])S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H25BrN2O5S/c19-15-5-7-16(8-6-15)27(25,26)21-12-9-14(10-13-21)18(24)20-11-3-1-2-4-17(22)23/h5-8,14H,1-4,9-13H2,(H,20,24)(H,22,23)/p-1